UCSF

ZINC00874249

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 19th, 2005 15 Yes

Popular Name: 1,2,3,4-Tetrahydro-isoquinoline-3-carboxylic acidethyl ester 1,2,3,4-Tetrahydro-isoquinoline-…

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CAS Numbers: 15912-55-7 , 57980-74-2

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.71 6.37 -38.87 2 3 1 43 206.265 3 ↓

Vendor Notes

Note Type Comments Provided By
Purity 95% Fluorochem
Warnings IRRITANT Matrix Scientific

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Analogs ( Draw Identity 99% 90% 80% 70% )